1-[3-[6-(diethylamino)pyrimidin-4-yl]phenyl]-3-phenyl-urea hydrochloride

Systemtic Name: 1-[3-[6-(diethylamino)pyrimidin-4-yl]phenyl]-3-phenyl-urea hydrochloride Openeye Name: 1-[3-[6-(diethylamino)pyrimidin-4-yl]phenyl]-3-phenyl-urea hydrochloride CAS Name: 1-[3-[6-(diethylamino)-4-pyrimidinyl]phenyl]-3-phenylurea hydrochloride IUPAC Name: 1-[3-[6-(diethylamino)pyrimidin-4-yl]phenyl]-3-phenylurea hydrochloride Traditional Name: 1-[3-[6-(diethylamino)pyrimidin-4-yl]phenyl]-3-phenyl-urea hydrochloride Formula: C21H24ClN5O MolecularWeight: 397.90116

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=NC=NC(=C1)C2=CC(=CC=C2)NC(=O)NC3=CC=CC=C3.Cl

Isomeric SMILES

CCN(CC)C1=NC=NC(=C1)C2=CC(=CC=C2)NC(=O)NC3=CC=CC=C3.Cl

InChI

InChI=1S/C21H23N5O.ClH/c1-3-26(4-2)20-14-19(22-15-23-20)16-9-8-12-18(13-16)25-21(27)24-17-10-6-5-7-11-17;/h5-15H,3-4H2,1-2H3,(H2,24,25,27);1H